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85168-87-2 | Butane,1-(2,2-dimethoxyethoxy)-
CAS No: 85168-87-2 Catalog No: AG004MX6 MDL No:
Product Description
Catalog Number:
AG004MX6
Chemical Name:
Butane,1-(2,2-dimethoxyethoxy)-
CAS Number:
85168-87-2
Molecular Formula:
C8H18O3
Molecular Weight:
162.2267
IUPAC Name:
1-(2,2-dimethoxyethoxy)butane
InChI:
InChI=1S/C8H18O3/c1-4-5-6-11-7-8(9-2)10-3/h8H,4-7H2,1-3H3
InChI Key:
NKPXTNPNZFWDCL-UHFFFAOYSA-N
SMILES:
CCCCOCC(OC)OC
EC Number:
285-929-1
Properties
Complexity:
71.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.126g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.229g/mol
Monoisotopic Mass:
162.126g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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